methyl 3-[(4-ethoxyphenyl)carbamoylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[(4-ethoxyphenyl)carbamoylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-[(4-ethoxyphenyl)carbamoylamino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[(4-ethoxyanilino)-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-ethoxyphenyl)carbamoylamino]-5-phenylthiophene-2-carboxylate Traditional Name: 5-phenyl-3-(p-phenetylcarbamoylamino)thiophene-2-carboxylic acid methyl ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)NC2=C(SC(=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H20N2O4S/c1-3-27-16-11-9-15(10-12-16)22-21(25)23-17-13-18(14-7-5-4-6-8-14)28-19(17)20(24)26-2/h4-13H,3H2,1-2H3,(H2,22,23,25)